Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 2/20 | 0.50 |
| ▸ | LTA4H | P09960 | 3/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20421057 | 1.00 | HDAC1 (0.60) | HDAC1HDAC6S1PR5S1PR1KDM1A | |
| SCHEMBL20420981 | 1.00 | HDAC1 (0.60) | HDAC1HDAC6S1PR5S1PR1KDM1A | |
| SCHEMBL20420978 | 0.96 | HDAC1 (0.57) | HDAC1HDAC6S1PR5S1PR1KDM1A | |
| SCHEMBL20421016 | 0.91 | HDAC1 (0.61) | HDAC1HDAC6S1PR5KDM1ALTA4H | |
| SCHEMBL20420884 | 0.89 | S1PR5 (0.53) | HDAC1HDAC6S1PR5S1PR1KDM1A | |
| SCHEMBL20420946 | 0.89 | HDAC1 (0.50) | HDAC1HDAC6S1PR5S1PR1LTA4H | |
| SCHEMBL20420920 | 0.89 | HDAC1 (0.50) | HDAC1HDAC6S1PR5S1PR1LTA4H | |
| SCHEMBL20421196 | 0.89 | HDAC1 (0.55) | HDAC1HDAC6HDAC4KCNH2MEN1 | |
| SCHEMBL20421017 | 0.89 | HDAC1 (0.55) | HDAC1HDAC6HDAC4KCNH2MEN1 | |
| SCHEMBL20420986 | 0.89 | HDAC1 (0.78) | HDAC1HDAC6S1PR5S1PR1DRD2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3116859-B1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-08-01 | — | — | EP | disclosed |